N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine

C15H24N4 — CID 43728825

IUPACN-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine
SMILESCC(NC1CCCN(c2ncccn2)C1)C1(C)CC1
InChIInChI=1S/C15H24N4/c1-12(15(2)6-7-15)18-13-5-3-10-19(11-13)14-16-8-4-9-17-14/h4,8-9,12-13,18H,3,5-7,10-11H2,1-2H3
InChIKeyHGUUTGBLXDYCSJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.22
Rot. Bonds4

About N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine

N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine (PubChem CID 43728825) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine.

Molecular Properties

Compound NameN-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine
PubChem CID43728825
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine
SMILESCC(NC1CCCN(c2ncccn2)C1)C1(C)CC1
InChIInChI=1S/C15H24N4/c1-12(15(2)6-7-15)18-13-5-3-10-19(11-13)14-16-8-4-9-17-14/h4,8-9,12-13,18H,3,5-7,10-11H2,1-2H3
InChIKeyHGUUTGBLXDYCSJ-UHFFFAOYSA-N
XLogP2.22
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-pyrimidin-2-ylpiperidin-3-yl)ethanol
CID 133397978
N-cyclohexyl-1-pyrimidin-2-ylpiperidin-3-amine
CID 43728828
(2R)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119857933
N-[1-(5-bromofuran-2-yl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine
CID 104652579
N-propan-2-yl-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675626
N-(3-methoxy-2-methylpropyl)-1-pyrimidin-2-ylpiperidin-3-amine
CID 116501051
3-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide;dihydrochloride
CID 120503187
(3S)-N-phenyl-1-pyrimidin-2-ylpiperidin-3-amine
CID 97226290
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 79024327
2-(aminomethyl)-3-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 65224744
(2R)-2-pyrazol-1-yl-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]propanamide
CID 95134540
(2S,3S)-2-amino-3-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)pentanamide
CID 61179360

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine?
The IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine (CID 43728825) is N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine.
What is the SMILES notation for N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine?
The canonical SMILES for N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine is CC(NC1CCCN(c2ncccn2)C1)C1(C)CC1.
What is the InChIKey of N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine?
The InChIKey is HGUUTGBLXDYCSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-12(15(2)6-7-15)18-13-5-3-10-19(11-13)14-16-8-4-9-17-14/h4,8-9,12-13,18H,3,5-7,10-11H2,1-2H3.
What are the key properties of N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine?
N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylcyclopropyl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine is sourced from PubChem (CID 43728825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).