N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine

C14H21N3 — CID 43166652

IUPACN-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
SMILESc1cc(N2CCC(NCC3CC3)CC2)ccn1
InChIInChI=1S/C14H21N3/c1-2-12(1)11-16-13-5-9-17(10-6-13)14-3-7-15-8-4-14/h3-4,7-8,12-13,16H,1-2,5-6,9-11H2
InChIKeyQVDYMEHFAUMQNX-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.05
Rot. Bonds4

About N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine

N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 43166652) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
PubChem CID43166652
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC NameN-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
SMILESc1cc(N2CCC(NCC3CC3)CC2)ccn1
InChIInChI=1S/C14H21N3/c1-2-12(1)11-16-13-5-9-17(10-6-13)14-3-7-15-8-4-14/h3-4,7-8,12-13,16H,1-2,5-6,9-11H2
InChIKeyQVDYMEHFAUMQNX-UHFFFAOYSA-N
XLogP2.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 113463722
N'-(1-pyridin-4-ylpiperidin-4-yl)butane-1,4-diamine
CID 60895619
N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166978
2-[(1-pyridin-4-ylpiperidin-4-yl)amino]ethyl carbamate
CID 83210815
2-[(1-pyridin-4-ylpiperidin-4-yl)amino]ethylurea
CID 83110952
2-methyl-3-[(1-pyridin-4-ylpiperidin-4-yl)amino]propan-1-ol
CID 65034705
1-(3-chloro-2-pyridinyl)-N-(cyclopropylmethyl)piperidin-4-amine
CID 113283451
2-methyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]butan-2-ol
CID 65108384
N'-ethyl-N'-methyl-N-(1-pyridin-4-ylpiperidin-4-yl)ethane-1,2-diamine
CID 55097459
N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 61351170
N-(2-methyl-2-methylsulfonylpropyl)-1-pyridin-4-ylpiperidin-4-amine
CID 79563479
N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine
CID 65231968

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine (CID 43166652) is N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine is c1cc(N2CCC(NCC3CC3)CC2)ccn1.
What is the InChIKey of N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is QVDYMEHFAUMQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-2-12(1)11-16-13-5-9-17(10-6-13)14-3-7-15-8-4-14/h3-4,7-8,12-13,16H,1-2,5-6,9-11H2.
What are the key properties of N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine?
N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 231.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 43166652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).