N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine

C16H24N2 — CID 103779083

IUPACN-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine
SMILESCC1CC1CNC1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H24N2/c1-13-11-14(13)12-17-15-7-9-18(10-8-15)16-5-3-2-4-6-16/h2-6,13-15,17H,7-12H2,1H3
InChIKeyKSJUKCHGNMVAHJ-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.90
Rot. Bonds4

About N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine

N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine (PubChem CID 103779083) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine
PubChem CID103779083
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine
SMILESCC1CC1CNC1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H24N2/c1-13-11-14(13)12-17-15-7-9-18(10-8-15)16-5-3-2-4-6-16/h2-6,13-15,17H,7-12H2,1H3
InChIKeyKSJUKCHGNMVAHJ-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 113463722
1-phenyl-N-[[(2S)-pyrrolidin-2-yl]methyl]piperidin-4-amine
CID 121498693
N-but-2-ynyl-1-phenylpiperidin-4-amine
CID 103905898
N-(3,3-dimethylbutyl)-1-phenylpiperidin-4-amine
CID 103779062
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine
CID 103096785
2,2-dimethyl-3-[(1-phenylpiperidin-4-yl)amino]propan-1-ol
CID 103904032
N-(3-cyclopropylpropyl)-1-phenylpiperidin-4-amine
CID 103902375
ethane;4-methyl-1-phenylpiperidine
CID 143180672
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-phenylpiperidin-4-amine
CID 103625283
N-(2-ethoxy-2-methylpropyl)-1-phenylpiperidin-4-amine
CID 102613559
4-methyl-1-[(1-phenylpiperidin-4-yl)amino]pentan-2-ol
CID 103779736
N-cyclobutyl-1-phenylpiperidin-4-amine
CID 103901830

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine?
The IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine (CID 103779083) is N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine.
What is the SMILES notation for N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine?
The canonical SMILES for N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine is CC1CC1CNC1CCN(c2ccccc2)CC1.
What is the InChIKey of N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine?
The InChIKey is KSJUKCHGNMVAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13-11-14(13)12-17-15-7-9-18(10-8-15)16-5-3-2-4-6-16/h2-6,13-15,17H,7-12H2,1H3.
What are the key properties of N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine?
N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine has a molecular weight of 244.38 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine is sourced from PubChem (CID 103779083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).