1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine

C18H23N3 — CID 106820380

IUPAC1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
SMILESC[C@@H](NC1CCN(c2ccccc2)CC1)c1ccccn1
InChIInChI=1S/C18H23N3/c1-15(18-9-5-6-12-19-18)20-16-10-13-21(14-11-16)17-7-3-2-4-8-17/h2-9,12,15-16,20H,10-11,13-14H2,1H3/t15-/m1/s1
InChIKeyKINPZISHIWERIK-OAHLLOKOSA-N
MW281.40 g/mol
LogP3.40
Rot. Bonds4

About 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine

1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine (PubChem CID 106820380) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
PubChem CID106820380
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
SMILESC[C@@H](NC1CCN(c2ccccc2)CC1)c1ccccn1
InChIInChI=1S/C18H23N3/c1-15(18-9-5-6-12-19-18)20-16-10-13-21(14-11-16)17-7-3-2-4-8-17/h2-9,12,15-16,20H,10-11,13-14H2,1H3/t15-/m1/s1
InChIKeyKINPZISHIWERIK-OAHLLOKOSA-N
XLogP3.40
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2'-Bipyridine
CID 1474
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
2-Pyridinemethanamine
CID 19509
2,2':6',2''-Terpyridine
CID 70848
Lanicemine
CID 9794203
Pyridine-2-carbothioic acid phenylamide
CID 759327
Bis(2-pyridylmethyl)amine
CID 73759
2-(2-(1-Piperidinyl)ethyl)pyridine
CID 79548
Betahistine Hydrochloride
CID 68643
1,2-Di(2-pyridyl)ethylene
CID 5374802
1-Pyridin-3-yl-1,4-diazepane
CID 10654891

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine?
The IUPAC name of 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine (CID 106820380) is 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine.
What is the SMILES notation for 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine?
The canonical SMILES for 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine is C[C@@H](NC1CCN(c2ccccc2)CC1)c1ccccn1.
What is the InChIKey of 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine?
The InChIKey is KINPZISHIWERIK-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H23N3/c1-15(18-9-5-6-12-19-18)20-16-10-13-21(14-11-16)17-7-3-2-4-8-17/h2-9,12,15-16,20H,10-11,13-14H2,1H3/t15-/m1/s1.
What are the key properties of 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine?
1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine is sourced from PubChem (CID 106820380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).