N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine

C12H20N4 — CID 62994036

IUPACN-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
SMILESCC(CNc1ccncn1)CN1CCCC1
InChIInChI=1S/C12H20N4/c1-11(9-16-6-2-3-7-16)8-14-12-4-5-13-10-15-12/h4-5,10-11H,2-3,6-9H2,1H3,(H,13,14,15)
InChIKeyOQAHFBSEUODXFQ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.62
Rot. Bonds5

About N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine

N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine (PubChem CID 62994036) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
PubChem CID62994036
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
SMILESCC(CNc1ccncn1)CN1CCCC1
InChIInChI=1S/C12H20N4/c1-11(9-16-6-2-3-7-16)8-14-12-4-5-13-10-15-12/h4-5,10-11H,2-3,6-9H2,1H3,(H,13,14,15)
InChIKeyOQAHFBSEUODXFQ-UHFFFAOYSA-N
XLogP1.62
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 133297711
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-4-nitropyridin-2-amine
CID 62994385
2-methyl-N-pyrimidin-4-ylbutane-1,4-diamine
CID 66107458
4-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidine-4,5-diamine
CID 79918788
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 66331043
N-(3-methyl-2-propan-2-ylbutyl)pyrimidin-4-amine
CID 102914055
5-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)pyrimidin-4-amine
CID 66340331
methyl 4-[(2-methyl-3-piperidin-1-ylpropyl)amino]pyrimidine-2-carboxylate
CID 66286242
N-[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]pyridin-2-amine
CID 86805423
N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
CID 94220826
6-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-2,6-diamine
CID 80647967
6-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrazin-2-amine
CID 62992157

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine?
The IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine (CID 62994036) is N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine.
What is the SMILES notation for N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine?
The canonical SMILES for N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine is CC(CNc1ccncn1)CN1CCCC1.
What is the InChIKey of N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine?
The InChIKey is OQAHFBSEUODXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-11(9-16-6-2-3-7-16)8-14-12-4-5-13-10-15-12/h4-5,10-11H,2-3,6-9H2,1H3,(H,13,14,15).
What are the key properties of N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine?
N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine is sourced from PubChem (CID 62994036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).