3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine

C14H30N4 — CID 55175188

IUPAC3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine
SMILESCN1CCC(CN(C)C2(CN)CCN(C)C2)CC1
InChIInChI=1S/C14H30N4/c1-16-7-4-13(5-8-16)10-18(3)14(11-15)6-9-17(2)12-14/h13H,4-12,15H2,1-3H3
InChIKeyLBIQXKGNPGATTO-UHFFFAOYSA-N
MW254.42 g/mol
LogP0.29
Rot. Bonds4

About 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine

3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine (PubChem CID 55175188) has the molecular formula C14H30N4 and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine
PubChem CID55175188
Molecular FormulaC14H30N4
Molecular Weight254.42 g/mol
Exact Mass254.25
IUPAC Name3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine
SMILESCN1CCC(CN(C)C2(CN)CCN(C)C2)CC1
InChIInChI=1S/C14H30N4/c1-16-7-4-13(5-8-16)10-18(3)14(11-15)6-9-17(2)12-14/h13H,4-12,15H2,1-3H3
InChIKeyLBIQXKGNPGATTO-UHFFFAOYSA-N
XLogP0.29
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-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

1-(aminomethyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63233140
3-(aminomethyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]thiolan-3-amine
CID 55175382
3-(aminomethyl)-N-(cyclopropylmethyl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine
CID 62975286
1-(aminomethyl)-4-ethyl-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]cyclohexan-1-amine
CID 63275986
4-(aminomethyl)-1-ethyl-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]azepan-4-amine
CID 65076127
3-(aminomethyl)-N,1,5-trimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 81467794
3-(aminomethyl)-N-(2-ethoxyethyl)-N,1-dimethylpyrrolidin-3-amine
CID 81059404
3-(aminomethyl)-N-cycloheptyl-N,1-dimethylpyrrolidin-3-amine
CID 62975279
4-(aminomethyl)-N-(cyclopentylmethyl)-N-methyl-1-propylpiperidin-4-amine
CID 55249827
3-(aminomethyl)-N-cyclopropyl-N-ethyl-1-methylpyrrolidin-3-amine
CID 62977308
4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine
CID 60984888
1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine
CID 60985128

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine?
The IUPAC name of 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine (CID 55175188) is 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine?
The canonical SMILES for 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine is CN1CCC(CN(C)C2(CN)CCN(C)C2)CC1.
What is the InChIKey of 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine?
The InChIKey is LBIQXKGNPGATTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4/c1-16-7-4-13(5-8-16)10-18(3)14(11-15)6-9-17(2)12-14/h13H,4-12,15H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine?
3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine has a molecular weight of 254.42 g/mol, XLogP of 0.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 55175188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).