N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C23H26N4O — CID 167797977

IUPACN-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCCC(c1ccccc1OC)N(C)c1nc(-c2ccccn2)nc2c1CCC2
InChIInChI=1S/C23H26N4O/c1-4-20(17-10-5-6-14-21(17)28-3)27(2)23-16-11-9-13-18(16)25-22(26-23)19-12-7-8-15-24-19/h5-8,10,12,14-15,20H,4,9,11,13H2,1-3H3
InChIKeyFZSGLPPETWLCNB-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.62
Rot. Bonds6

About N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 167797977) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID167797977
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC NameN-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCCC(c1ccccc1OC)N(C)c1nc(-c2ccccn2)nc2c1CCC2
InChIInChI=1S/C23H26N4O/c1-4-20(17-10-5-6-14-21(17)28-3)27(2)23-16-11-9-13-18(16)25-22(26-23)19-12-7-8-15-24-19/h5-8,10,12,14-15,20H,4,9,11,13H2,1-3H3
InChIKeyFZSGLPPETWLCNB-UHFFFAOYSA-N
XLogP4.62
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine with MolForge

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Related Compounds

methyl 3-methyl-2-[methyl-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]butanoate
CID 157030331
N-ethyl-5-methoxy-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 51042235
N-ethyl-2-pyridin-2-yl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63351510
(3S)-3-[methyl-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]-1-phenylpyrrolidin-2-one
CID 157029421
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)propyl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133355766
N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine
CID 86806537
4-(2-ethoxyphenyl)-2-pyridin-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 121456189
N-[(2-methoxyphenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56584629
(3R)-4-methylsulfanyl-3-[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]butan-1-ol
CID 95775354
N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-pyridin-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine
CID 56914948
2-pyridin-2-yl-N-[(1S)-1-pyridin-4-ylethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 124626058
N,5,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 56563771

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 167797977) is N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is CCC(c1ccccc1OC)N(C)c1nc(-c2ccccn2)nc2c1CCC2.
What is the InChIKey of N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is FZSGLPPETWLCNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-4-20(17-10-5-6-14-21(17)28-3)27(2)23-16-11-9-13-18(16)25-22(26-23)19-12-7-8-15-24-19/h5-8,10,12,14-15,20H,4,9,11,13H2,1-3H3.
What are the key properties of N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 374.49 g/mol, XLogP of 4.62, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)propyl]-N-methyl-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 167797977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).