N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine

C11H18N2 — CID 67725342

IUPACN-[(3R)-2-methylpentan-3-yl]pyridin-3-amine
SMILESCC[C@@H](Nc1cccnc1)C(C)C
InChIInChI=1S/C11H18N2/c1-4-11(9(2)3)13-10-6-5-7-12-8-10/h5-9,11,13H,4H2,1-3H3/t11-/m1/s1
InChIKeyOAXGCVZVYPACRT-LLVKDONJSA-N
MW178.28 g/mol
LogP2.93
Rot. Bonds4

About N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine

N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine (PubChem CID 67725342) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine.

Molecular Properties

Compound NameN-[(3R)-2-methylpentan-3-yl]pyridin-3-amine
PubChem CID67725342
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN-[(3R)-2-methylpentan-3-yl]pyridin-3-amine
SMILESCC[C@@H](Nc1cccnc1)C(C)C
InChIInChI=1S/C11H18N2/c1-4-11(9(2)3)13-10-6-5-7-12-8-10/h5-9,11,13H,4H2,1-3H3/t11-/m1/s1
InChIKeyOAXGCVZVYPACRT-LLVKDONJSA-N
XLogP2.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylbutyl)pyridin-3-amine
CID 43200734
N-(5-methylhexan-2-yl)pyridin-3-amine
CID 43190619
2-(pyridin-3-ylamino)propan-1-ol
CID 166774410
3-methoxy-N-[(3S)-2-methylpentan-3-yl]aniline
CID 93283290
2-(pyridin-3-ylamino)butanoic acid
CID 90735092
molecular hydrogen;1-(pyridin-3-ylamino)ethanethiol
CID 143056439
2-methyl-N-(2-pyridin-3-yloxyethyl)pentan-3-amine
CID 115720180
3-fluoro-N-[(3S)-2-methylpentan-3-yl]aniline
CID 93282117
N-(2-methylpentan-3-yl)-3-(1,3-oxazol-5-yl)aniline
CID 54865092
5-N-(2-methylpentan-3-yl)isoquinoline-5,8-diamine
CID 54954555
(2S)-3-methyl-2-(pyridin-3-ylamino)butanoic acid
CID 59166574
3-methyl-N-pyridin-3-ylpentanamide
CID 142960765

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine?
The IUPAC name of N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine (CID 67725342) is N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine.
What is the SMILES notation for N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine?
The canonical SMILES for N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine is CC[C@@H](Nc1cccnc1)C(C)C.
What is the InChIKey of N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine?
The InChIKey is OAXGCVZVYPACRT-LLVKDONJSA-N. The full InChI is InChI=1S/C11H18N2/c1-4-11(9(2)3)13-10-6-5-7-12-8-10/h5-9,11,13H,4H2,1-3H3/t11-/m1/s1.
What are the key properties of N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine?
N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine has a molecular weight of 178.28 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-2-methylpentan-3-yl]pyridin-3-amine is sourced from PubChem (CID 67725342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).