N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine

C12H19N3 — CID 61241873

IUPACN-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCC2CCC2)ncn1
InChIInChI=1S/C12H19N3/c1-2-4-11-7-12(15-9-14-11)13-8-10-5-3-6-10/h7,9-10H,2-6,8H2,1H3,(H,13,14,15)
InChIKeyKVNLZILULAWDCY-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.64
Rot. Bonds5

About N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine

N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine (PubChem CID 61241873) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
PubChem CID61241873
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC NameN-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCC2CCC2)ncn1
InChIInChI=1S/C12H19N3/c1-2-4-11-7-12(15-9-14-11)13-8-10-5-3-6-10/h7,9-10H,2-6,8H2,1H3,(H,13,14,15)
InChIKeyKVNLZILULAWDCY-UHFFFAOYSA-N
XLogP2.64
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
N-(3-cyclopentylpropyl)-6-propylpyrimidin-4-amine
CID 106012599
6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
CID 79363066
4-N-(cyclohexylmethyl)-6-N-propylpyrimidine-4,6-diamine
CID 80784186
N-(cyclobutylmethyl)-6-fluoropyrimidin-4-amine
CID 115416489
N-(cyclopropylmethyl)-6-(fluoromethyl)pyrimidin-4-amine
CID 126849132
N-(2-methoxy-2-methylpropyl)-6-propylpyrimidin-4-amine
CID 104762532
4-N-[(4-methylcyclohexyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80828903
4-N-(1-amino-2-methylpropan-2-yl)-6-N-(cyclobutylmethyl)pyrimidine-4,6-diamine
CID 115263895
N-[(3-aminocyclohexyl)methyl]-6-ethoxypyrimidin-4-amine
CID 106128479
N-ethyl-N'-(6-propylpyrimidin-4-yl)propane-1,3-diamine
CID 61241880
methyl 2-[(6-propylpyrimidin-4-yl)amino]acetate
CID 61240139

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine?
The IUPAC name of N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine (CID 61241873) is N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine?
The canonical SMILES for N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine is CCCc1cc(NCC2CCC2)ncn1.
What is the InChIKey of N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine?
The InChIKey is KVNLZILULAWDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-2-4-11-7-12(15-9-14-11)13-8-10-5-3-6-10/h7,9-10H,2-6,8H2,1H3,(H,13,14,15).
What are the key properties of N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine?
N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine has a molecular weight of 205.30 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 61241873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).