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

C15H23N3 — CID 113463722

IUPACN-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
SMILESCC1CC1CNC1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H23N3/c1-12-10-13(12)11-17-14-4-8-18(9-5-14)15-2-6-16-7-3-15/h2-3,6-7,12-14,17H,4-5,8-11H2,1H3
InChIKeyFCODEVGEWKTVMJ-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.30
Rot. Bonds4

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

N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 113463722) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
PubChem CID113463722
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
SMILESCC1CC1CNC1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H23N3/c1-12-10-13(12)11-17-14-4-8-18(9-5-14)15-2-6-16-7-3-15/h2-3,6-7,12-14,17H,4-5,8-11H2,1H3
InChIKeyFCODEVGEWKTVMJ-UHFFFAOYSA-N
XLogP2.30
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine
CID 103779083
N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166652
N-(2-methyl-2-methylsulfonylpropyl)-1-pyridin-4-ylpiperidin-4-amine
CID 79563479
N-(2,4-dimethylcyclohexyl)-1-pyridin-4-ylpiperidin-4-amine
CID 63996073
2-methyl-3-[(1-pyridin-4-ylpiperidin-4-yl)amino]propan-1-ol
CID 65034705
N'-(1-pyridin-4-ylpiperidin-4-yl)butane-1,4-diamine
CID 60895619
N'-ethyl-N'-methyl-N-(1-pyridin-4-ylpiperidin-4-yl)ethane-1,2-diamine
CID 55097459
2-methyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]butan-2-ol
CID 65108384
N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166978
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 79231652
N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 61351170
N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine
CID 43371759

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine (CID 113463722) is N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine is CC1CC1CNC1CCN(c2ccncc2)CC1.
What is the InChIKey of N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is FCODEVGEWKTVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-12-10-13(12)11-17-14-4-8-18(9-5-14)15-2-6-16-7-3-15/h2-3,6-7,12-14,17H,4-5,8-11H2,1H3.
What are the key properties of N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine?
N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 245.37 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 113463722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).