N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine

C14H24N4O — CID 115365986

IUPACN-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine
SMILESCC(C)Oc1cc(NCC2(CN)CCCC2)ncn1
InChIInChI=1S/C14H24N4O/c1-11(2)19-13-7-12(17-10-18-13)16-9-14(8-15)5-3-4-6-14/h7,10-11H,3-6,8-9,15H2,1-2H3,(H,16,17,18)
InChIKeyNMAXXSYXBVYLND-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.19
Rot. Bonds6

About N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine

N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine (PubChem CID 115365986) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine
PubChem CID115365986
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine
SMILESCC(C)Oc1cc(NCC2(CN)CCCC2)ncn1
InChIInChI=1S/C14H24N4O/c1-11(2)19-13-7-12(17-10-18-13)16-9-14(8-15)5-3-4-6-14/h7,10-11H,3-6,8-9,15H2,1-2H3,(H,16,17,18)
InChIKeyNMAXXSYXBVYLND-UHFFFAOYSA-N
XLogP2.19
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-(aminomethyl)cyclopropyl]methyl]-6-propoxypyrimidin-4-amine
CID 113313752
N-[[1-(aminomethyl)cyclohexyl]methyl]-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 103970503
N-[[1-(chloromethyl)cyclopentyl]methyl]-6-methoxypyrimidin-4-amine
CID 115363649
N-[[1-(chloromethyl)cyclopentyl]methyl]-6-ethoxypyrimidin-4-amine
CID 113294686
N'-propan-2-yl-N-(6-propan-2-yloxypyrimidin-4-yl)ethane-1,2-diamine
CID 66334042
[1-[[(6-ethoxypyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103967277
[1-[[(6-propoxypyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115360640
6-propan-2-yloxy-N-(2,3,3-trimethylbutyl)pyrimidin-4-amine
CID 83143319
2-ethyl-1-N-(6-propan-2-yloxypyrimidin-4-yl)butane-1,2-diamine
CID 113283234
2-[(6-propan-2-yloxypyrimidin-4-yl)amino]acetic acid
CID 66334030
N-[[1-(aminomethyl)cyclopentyl]methyl]-6-methoxypyridin-2-amine
CID 115366027
N-[(1-ethylcyclopentyl)methyl]-6-methylpyrimidin-4-amine
CID 103764979

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine (CID 115365986) is N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine is CC(C)Oc1cc(NCC2(CN)CCCC2)ncn1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine?
The InChIKey is NMAXXSYXBVYLND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11(2)19-13-7-12(17-10-18-13)16-9-14(8-15)5-3-4-6-14/h7,10-11H,3-6,8-9,15H2,1-2H3,(H,16,17,18).
What are the key properties of N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine?
N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopentyl]methyl]-6-propan-2-yloxypyrimidin-4-amine is sourced from PubChem (CID 115365986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).