N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

C15H24N4 — CID 55153997

IUPACN-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCN(c1nccc(C)n1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H24N4/c1-3-8-19(15-16-7-6-11(2)17-15)14-9-12-4-5-13(10-14)18-12/h6-7,12-14,18H,3-5,8-10H2,1-2H3
InChIKeyCSJNGBXIISOXQV-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.28
Rot. Bonds4

About N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 55153997) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID55153997
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCN(c1nccc(C)n1)C1CC2CCC(C1)N2
InChIInChI=1S/C15H24N4/c1-3-8-19(15-16-7-6-11(2)17-15)14-9-12-4-5-13(10-14)18-12/h6-7,12-14,18H,3-5,8-10H2,1-2H3
InChIKeyCSJNGBXIISOXQV-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-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

N-propyl-N-pyrimidin-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232894
N-propyl-N-pyrazin-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232893
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]pyrimidine-4-carbonitrile
CID 107552429
N-(2-chloroethyl)-N-cyclopentyl-4-methylpyrimidin-2-amine
CID 63388934
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylquinazolin-2-amine
CID 114789417
2-N-cyclopropyl-2-N-propylpyrimidine-2,4-diamine
CID 116796417
N-(5-bromo-3-methyl-2-pyridinyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 79717810
2-[8-azabicyclo[3.2.1]octan-3-yl(propyl)amino]pyridine-3-carboxamide
CID 61232537
N-(1-propan-2-ylimidazol-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 106552189
4-(aminomethyl)-N-cyclopropyl-N-propylpyrimidin-2-amine
CID 107541562
N-(3-nitro-2-pyridinyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232892
N-(4-methyl-1-prop-2-enylimidazol-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 106552193

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (CID 55153997) is N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is CCCN(c1nccc(C)n1)C1CC2CCC(C1)N2.
What is the InChIKey of N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is CSJNGBXIISOXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-3-8-19(15-16-7-6-11(2)17-15)14-9-12-4-5-13(10-14)18-12/h6-7,12-14,18H,3-5,8-10H2,1-2H3.
What are the key properties of N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpyrimidin-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 55153997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).