N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine

C15H26N2 — CID 80522237

IUPACN-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine
SMILESCCC(C)C(CNC(C)(C)C)c1cccnc1
InChIInChI=1S/C15H26N2/c1-6-12(2)14(11-17-15(3,4)5)13-8-7-9-16-10-13/h7-10,12,14,17H,6,11H2,1-5H3
InChIKeySNARLHDRGJXALN-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.60
Rot. Bonds5

About N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine

N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine (PubChem CID 80522237) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine
PubChem CID80522237
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine
SMILESCCC(C)C(CNC(C)(C)C)c1cccnc1
InChIInChI=1S/C15H26N2/c1-6-12(2)14(11-17-15(3,4)5)13-8-7-9-16-10-13/h7-10,12,14,17H,6,11H2,1-5H3
InChIKeySNARLHDRGJXALN-UHFFFAOYSA-N
XLogP3.60
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-3-methyl-2-pyridin-4-ylhexan-1-amine
CID 107887241
N,3-dimethyl-2-pyridin-3-ylhexan-1-amine
CID 107887227
(1S)-2-methyl-1-pyridin-3-ylbutan-1-amine
CID 130856661
N-ethyl-3,5-dimethyl-2-pyridin-3-ylhexan-1-amine
CID 114284954
2-methyl-N-propyl-1-pyridin-3-ylbutan-1-amine
CID 63716862
2-methyl-N-(2-phenyl-3-pyridin-3-ylpropyl)propan-2-amine
CID 81023850
2-amino-3-methyl-N-[(1S)-1-pyridin-3-ylethyl]pentanamide
CID 81405246
3-methyl-2-pyridin-3-ylpentanoic acid
CID 80522853
2-N,2-N-dimethyl-1-N-(1-pyridin-3-ylethyl)butane-1,2-diamine
CID 115886281
3-(3,3-dimethylbutan-2-yl)pyridine
CID 59751404
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773
1-[(2-methylpropan-2-yl)oxy]-3-[[(1R)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 81405230

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine?
The IUPAC name of N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine (CID 80522237) is N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine.
What is the SMILES notation for N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine?
The canonical SMILES for N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine is CCC(C)C(CNC(C)(C)C)c1cccnc1.
What is the InChIKey of N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine?
The InChIKey is SNARLHDRGJXALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-6-12(2)14(11-17-15(3,4)5)13-8-7-9-16-10-13/h7-10,12,14,17H,6,11H2,1-5H3.
What are the key properties of N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine?
N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine is sourced from PubChem (CID 80522237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).