N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine

C16H34N2 — CID 62262259

IUPACN-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine
SMILESCCC(C)(CNC(C)(C)C)CN1CCCC(C)C1
InChIInChI=1S/C16H34N2/c1-7-16(6,12-17-15(3,4)5)13-18-10-8-9-14(2)11-18/h14,17H,7-13H2,1-6H3
InChIKeyCVIGJQQIZOECKZ-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds5

About N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine

N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine (PubChem CID 62262259) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine
PubChem CID62262259
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine
SMILESCCC(C)(CNC(C)(C)C)CN1CCCC(C)C1
InChIInChI=1S/C16H34N2/c1-7-16(6,12-17-15(3,4)5)13-18-10-8-9-14(2)11-18/h14,17H,7-13H2,1-6H3
InChIKeyCVIGJQQIZOECKZ-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butyl]cyclopropanamine
CID 62262258
N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
CID 62263552
N-tert-butyl-2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylbutan-1-amine
CID 106588959
N-tert-butyl-2-methyl-2-[(4-propylpiperidin-1-yl)methyl]butan-1-amine
CID 63494021
N-tert-butyl-2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylbutan-1-amine
CID 62258109
N-tert-butyl-2,2-dimethyl-3-(4-methylazepan-1-yl)propan-1-amine
CID 55249989
1-[1-[2-[(tert-butylamino)methyl]-2-methylbutyl]piperidin-4-yl]ethanol
CID 106837835
N-[2,2-dimethyl-3-(3-methylpiperidin-1-yl)propyl]cyclopropanamine
CID 62263551
N-tert-butyl-2-[(3,4-dimethylpiperazin-1-yl)methyl]-2-methylpentan-1-amine
CID 63635318
2-methyl-2-[(4-methylazepan-1-yl)methyl]-N-(2-methylpropyl)butan-1-amine
CID 63624510
N-tert-butyl-2-methyl-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]butan-1-amine
CID 114596807
2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
CID 62262995

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine?
The IUPAC name of N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine (CID 62262259) is N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine.
What is the SMILES notation for N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine?
The canonical SMILES for N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine is CCC(C)(CNC(C)(C)C)CN1CCCC(C)C1.
What is the InChIKey of N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine?
The InChIKey is CVIGJQQIZOECKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-16(6,12-17-15(3,4)5)13-18-10-8-9-14(2)11-18/h14,17H,7-13H2,1-6H3.
What are the key properties of N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine?
N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine is sourced from PubChem (CID 62262259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).