N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine

C12H20N2 — CID 81401489

IUPACN-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
SMILESCCCC(C)N[C@H](C)c1ccccn1
InChIInChI=1S/C12H20N2/c1-4-7-10(2)14-11(3)12-8-5-6-9-13-12/h5-6,8-11,14H,4,7H2,1-3H3/t10?,11-/m1/s1
InChIKeyICEGKUCRRUDONR-RRKGBCIJSA-N
MW192.31 g/mol
LogP2.92
Rot. Bonds5

About N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine

N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine (PubChem CID 81401489) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine.

Molecular Properties

Compound NameN-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
PubChem CID81401489
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
SMILESCCCC(C)N[C@H](C)c1ccccn1
InChIInChI=1S/C12H20N2/c1-4-7-10(2)14-11(3)12-8-5-6-9-13-12/h5-6,8-11,14H,4,7H2,1-3H3/t10?,11-/m1/s1
InChIKeyICEGKUCRRUDONR-RRKGBCIJSA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[(1S)-1-pyridin-2-ylethyl]hex-5-en-2-amine
CID 97358759
4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine
CID 43205350
4-[3-(1-pyridin-2-ylethylamino)butyl]phenol
CID 43202604
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81402254
N-(1-iodoethyl)-1-pyridin-2-ylethanamine
CID 174262770
(2S)-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]butan-2-amine
CID 28648178
(2R)-2-(1-pyridin-2-ylbutylamino)propan-1-ol
CID 103878434
3-(1-pyridin-2-ylethylamino)butanamide
CID 115572776
4-methoxy-4-methyl-N-[(1S)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81399712
3-methyl-2-(1-pyridin-2-ylethylamino)butan-1-ol
CID 79253644
4-methoxy-3-(1-pyridin-2-ylethylamino)butan-1-ol
CID 115872140
methyl 2-[[(1S)-1-pyridin-2-ylethyl]amino]hexanoate
CID 113341980

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine?
The IUPAC name of N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine (CID 81401489) is N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine.
What is the SMILES notation for N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine?
The canonical SMILES for N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine is CCCC(C)N[C@H](C)c1ccccn1.
What is the InChIKey of N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine?
The InChIKey is ICEGKUCRRUDONR-RRKGBCIJSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-7-10(2)14-11(3)12-8-5-6-9-13-12/h5-6,8-11,14H,4,7H2,1-3H3/t10?,11-/m1/s1.
What are the key properties of N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine?
N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine is sourced from PubChem (CID 81401489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).