(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine

C12H19N3 — CID 39254713

IUPAC(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine
SMILESNC[C@H](c1ccncc1)N1CCCCC1
InChIInChI=1S/C12H19N3/c13-10-12(11-4-6-14-7-5-11)15-8-2-1-3-9-15/h4-7,12H,1-3,8-10,13H2/t12-/m1/s1
InChIKeyUVTPSVJPZZHEDH-GFCCVEGCSA-N
MW205.31 g/mol
LogP1.57
Rot. Bonds3

About (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine

(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine (PubChem CID 39254713) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine
PubChem CID39254713
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine
SMILESNC[C@H](c1ccncc1)N1CCCCC1
InChIInChI=1S/C12H19N3/c13-10-12(11-4-6-14-7-5-11)15-8-2-1-3-9-15/h4-7,12H,1-3,8-10,13H2/t12-/m1/s1
InChIKeyUVTPSVJPZZHEDH-GFCCVEGCSA-N
XLogP1.57
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
CID 30075732
2-(4-butan-2-ylpiperazin-1-yl)-2-pyridin-4-ylethanamine
CID 62774987
4-(2-amino-1-piperidin-1-ylethyl)phenol
CID 16796139
(2S)-2-(azepan-1-yl)-2-(4-methylphenyl)ethanamine
CID 9079311
2-(azepan-1-yl)-2-(4-fluorophenyl)ethanamine
CID 6484142
2-(azepan-1-yl)-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 16792257
(2S)-2-(4-ethylphenyl)-2-piperidin-1-ylethanamine
CID 97182151
2-(4-methylsulfonylpiperazin-1-yl)-2-pyridin-4-ylethanamine
CID 55133317
(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ylethanamine
CID 97182150
4-(2-amino-1-piperidin-1-ylethyl)-N,N-dimethylaniline
CID 16642839
2-(azepan-1-yl)-2-(4-cyclopropylphenyl)ethanamine
CID 79984707
2-(azocan-1-yl)-2-(6-methyl-3-pyridinyl)ethanamine
CID 113457077

Frequently Asked Questions

What is the IUPAC name of (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine?
The IUPAC name of (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine (CID 39254713) is (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine.
What is the SMILES notation for (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine?
The canonical SMILES for (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine is NC[C@H](c1ccncc1)N1CCCCC1.
What is the InChIKey of (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine?
The InChIKey is UVTPSVJPZZHEDH-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H19N3/c13-10-12(11-4-6-14-7-5-11)15-8-2-1-3-9-15/h4-7,12H,1-3,8-10,13H2/t12-/m1/s1.
What are the key properties of (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine?
(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine has a molecular weight of 205.31 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 39254713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).