1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine

C14H30N2 — CID 43748354

IUPAC1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine
SMILESCCCCN1CCC(NC(C)C(C)C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-9-16-10-7-14(8-11-16)15-13(4)12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyQHQWYIZPBCVVDX-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds6

About 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine

1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine (PubChem CID 43748354) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine
PubChem CID43748354
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine
SMILESCCCCN1CCC(NC(C)C(C)C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-9-16-10-7-14(8-11-16)15-13(4)12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyQHQWYIZPBCVVDX-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-N-propan-2-ylpiperidin-4-amine
CID 43748392
1-(2-methoxyethyl)-N-(3-methylbutan-2-yl)piperidin-4-amine
CID 115707229
1-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethyl]-N-propan-2-ylpiperidin-4-amine
CID 155405108
1-butyl-N-ethylpiperidin-4-amine
CID 43314967
1-butyl-N-[1-(4-methylphenyl)ethyl]piperidin-4-amine
CID 43748363
1-butyl-N-[1-(2-chlorophenyl)ethyl]piperidin-4-amine
CID 43748320
1-dodecyl-N-methylpiperidin-4-amine
CID 63400682
N-ethyl-1-pentylpiperidin-4-amine
CID 43315098
methyl 2-methyl-3-[(1-propylpiperidin-4-yl)amino]butanoate
CID 79392073
1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine
CID 61325567
N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
N-[1-(1-butylpiperidin-4-yl)ethyl]propan-1-amine
CID 63855012

Frequently Asked Questions

What is the IUPAC name of 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine?
The IUPAC name of 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine (CID 43748354) is 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine?
The canonical SMILES for 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine is CCCCN1CCC(NC(C)C(C)C)CC1.
What is the InChIKey of 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine?
The InChIKey is QHQWYIZPBCVVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-6-9-16-10-7-14(8-11-16)15-13(4)12(2)3/h12-15H,5-11H2,1-4H3.
What are the key properties of 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine?
1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine is sourced from PubChem (CID 43748354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).