3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine

C13H23N3 — CID 79412342

IUPAC3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine
SMILESCCCCC(NC(C)C)c1cccnc1N
InChIInChI=1S/C13H23N3/c1-4-5-8-12(16-10(2)3)11-7-6-9-15-13(11)14/h6-7,9-10,12,16H,4-5,8H2,1-3H3,(H2,14,15)
InChIKeyMJQNJAHMVIEQTD-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.89
Rot. Bonds6

About 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine

3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine (PubChem CID 79412342) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine
PubChem CID79412342
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine
SMILESCCCCC(NC(C)C)c1cccnc1N
InChIInChI=1S/C13H23N3/c1-4-5-8-12(16-10(2)3)11-7-6-9-15-13(11)14/h6-7,9-10,12,16H,4-5,8H2,1-3H3,(H2,14,15)
InChIKeyMJQNJAHMVIEQTD-UHFFFAOYSA-N
XLogP2.89
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-hydrazinyl-4-methylpentyl)pyridin-2-amine
CID 105207559
1-(2-amino-3-pyridinyl)-N',N'-diethyl-N-propylpropane-1,3-diamine
CID 79092747
3-[1-(methylamino)-2-propylsulfanylethyl]pyridin-2-amine
CID 65128801
3-[3-ethoxy-1-(methylamino)propyl]pyridin-2-amine
CID 106815072
3-[(3S)-2-methylpentan-3-yl]pyridin-2-amine
CID 176663633
1-quinolin-5-ylpentylhydrazine
CID 105245773
3-[4,4,4-trifluoro-1-(methylamino)butyl]pyridin-2-amine
CID 79954451
(3R)-3-(2-chloro-3-pyridinyl)-3-(propan-2-ylamino)propan-1-ol
CID 97174936
3-N-octan-4-ylpyridine-2,3-diamine
CID 106022702
3-[(1R)-1-amino-4-methylpentyl]pyridin-2-amine
CID 171211340
1-(2-methoxy-3-pyridinyl)-N-methylpentan-1-amine
CID 105125538
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912

Frequently Asked Questions

What is the IUPAC name of 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine?
The IUPAC name of 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine (CID 79412342) is 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine.
What is the SMILES notation for 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine?
The canonical SMILES for 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine is CCCCC(NC(C)C)c1cccnc1N.
What is the InChIKey of 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine?
The InChIKey is MJQNJAHMVIEQTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-5-8-12(16-10(2)3)11-7-6-9-15-13(11)14/h6-7,9-10,12,16H,4-5,8H2,1-3H3,(H2,14,15).
What are the key properties of 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine?
3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine has a molecular weight of 221.35 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(propan-2-ylamino)pentyl]pyridin-2-amine is sourced from PubChem (CID 79412342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).