1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine

C14H30N2 — CID 61325567

IUPAC1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine
SMILESCCCCN1CCC(NCC(C)(C)C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-9-16-10-7-13(8-11-16)15-12-14(2,3)4/h13,15H,5-12H2,1-4H3
InChIKeySERKGNPZWJYMFP-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.89
Rot. Bonds5

About 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine

1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine (PubChem CID 61325567) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine.

Molecular Properties

Compound Name1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine
PubChem CID61325567
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine
SMILESCCCCN1CCC(NCC(C)(C)C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-9-16-10-7-13(8-11-16)15-12-14(2,3)4/h13,15H,5-12H2,1-4H3
InChIKeySERKGNPZWJYMFP-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-N-ethylpiperidin-4-amine
CID 43314967
N-ethyl-1-pentylpiperidin-4-amine
CID 43315098
1-dodecyl-N-ethylpiperidin-4-amine
CID 63400728
N-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103640946
N-(2,2-dimethylpropyl)-1-prop-2-enylpiperidin-4-amine
CID 115616300
N-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperidin-4-amine;hydrochloride
CID 115607087
1-butyl-N-propan-2-ylpiperidin-4-amine
CID 43748392
1-(3-butoxypropyl)-N-ethylpiperidin-4-amine
CID 113481126
1-butyl-N-(oxan-4-ylmethyl)piperidin-4-amine
CID 62386509
1-butyl-N-(3-ethylsulfanylpropyl)piperidin-4-amine
CID 113373351
1-dodecyl-N-methylpiperidin-4-amine
CID 63400682
1-butyl-N-(pyrrolidin-2-ylmethyl)piperidin-4-amine
CID 106637748

Frequently Asked Questions

What is the IUPAC name of 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine?
The IUPAC name of 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine (CID 61325567) is 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine.
What is the SMILES notation for 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine?
The canonical SMILES for 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine is CCCCN1CCC(NCC(C)(C)C)CC1.
What is the InChIKey of 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine?
The InChIKey is SERKGNPZWJYMFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-6-9-16-10-7-13(8-11-16)15-12-14(2,3)4/h13,15H,5-12H2,1-4H3.
What are the key properties of 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine?
1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine has a molecular weight of 226.41 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-N-(2,2-dimethylpropyl)piperidin-4-amine is sourced from PubChem (CID 61325567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).