3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine

C13H28N2 — CID 43434983

IUPAC3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
SMILESCC(C)CCNC(C)CN1CCCCC1
InChIInChI=1S/C13H28N2/c1-12(2)7-8-14-13(3)11-15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3
InChIKeyUBMLPZXUJFWXCD-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.50
Rot. Bonds6

About 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine

3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine (PubChem CID 43434983) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
PubChem CID43434983
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
SMILESCC(C)CCNC(C)CN1CCCCC1
InChIInChI=1S/C13H28N2/c1-12(2)7-8-14-13(3)11-15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3
InChIKeyUBMLPZXUJFWXCD-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)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-fluoroethyl)-1-pyrrolidin-1-ylpropan-2-amine
CID 80693865
5-methyl-N-(1-piperidin-1-ylpropan-2-yl)hexan-2-amine
CID 43749079
N-[2-(2-methylpropoxy)ethyl]-1-piperidin-1-ylpropan-2-amine
CID 106451807
N-(1-piperidin-1-ylpropan-2-yl)hexan-1-amine
CID 43749038
N-(3-methylsulfanylpropyl)-1-piperidin-1-ylpropan-2-amine
CID 43434982
2-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
CID 43749022
5-(1-pyrrolidin-1-ylpropan-2-ylamino)pentan-1-ol
CID 62228276
N',N'-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)propane-1,3-diamine
CID 114525110
1-(1-piperidin-1-ylpropan-2-ylamino)-3-pyrrolidin-1-ylpropan-2-ol
CID 61499979
5-(1-piperidin-1-ylpropan-2-ylamino)pentanamide
CID 114281596
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
N-[2-(3-methoxypropoxy)ethyl]-1-piperidin-1-ylpropan-2-amine
CID 103178774

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine?
The IUPAC name of 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine (CID 43434983) is 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine.
What is the SMILES notation for 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine?
The canonical SMILES for 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine is CC(C)CCNC(C)CN1CCCCC1.
What is the InChIKey of 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine?
The InChIKey is UBMLPZXUJFWXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-12(2)7-8-14-13(3)11-15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3.
What are the key properties of 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine?
3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine is sourced from PubChem (CID 43434983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).