N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine

C14H22N4 — CID 106643689

IUPACN-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
SMILESCc1nccc(N(CC2CCCNC2)C2CC2)n1
InChIInChI=1S/C14H22N4/c1-11-16-8-6-14(17-11)18(13-4-5-13)10-12-3-2-7-15-9-12/h6,8,12-13,15H,2-5,7,9-10H2,1H3
InChIKeyPOOHFQBYMDZYMV-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.75
Rot. Bonds4

About N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine

N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine (PubChem CID 106643689) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
PubChem CID106643689
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC NameN-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
SMILESCc1nccc(N(CC2CCCNC2)C2CC2)n1
InChIInChI=1S/C14H22N4/c1-11-16-8-6-14(17-11)18(13-4-5-13)10-12-3-2-7-15-9-12/h6,8,12-13,15H,2-5,7,9-10H2,1H3
InChIKeyPOOHFQBYMDZYMV-UHFFFAOYSA-N
XLogP1.75
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopropyl(piperidin-3-ylmethyl)amino]-6-methylpyridine-4-carbonitrile
CID 106643778
6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide
CID 106643858
N-cyclopropyl-1-methyl-N-(piperidin-3-ylmethyl)imidazo[4,5-c]pyridin-4-amine
CID 106643721
N-cyclopropyl-4-methyl-5-nitro-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 106643758
4-[cyclopropyl(piperidin-3-ylmethyl)amino]-2,6-dimethylpyridine-3-carbonitrile
CID 106643759
N'-cyclopropyl-N'-(2-methylpyrimidin-4-yl)propane-1,3-diamine
CID 62785297
N,2-dimethyl-N-(piperidin-3-ylmethyl)pyridin-4-amine
CID 83837363
N-ethyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106643619
N-cyclopropyl-N-(piperidin-3-ylmethyl)quinazolin-4-amine
CID 106643652
N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CID 71642131
N-methyl-N-(piperidin-3-ylmethyl)pyrazin-2-amine;hydrochloride
CID 71642141
N,6-diethyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106643375

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine (CID 106643689) is N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine is Cc1nccc(N(CC2CCCNC2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine?
The InChIKey is POOHFQBYMDZYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-11-16-8-6-14(17-11)18(13-4-5-13)10-12-3-2-7-15-9-12/h6,8,12-13,15H,2-5,7,9-10H2,1H3.
What are the key properties of N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine?
N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine has a molecular weight of 246.36 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 106643689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).