2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine

C12H27N3 — CID 83835390

IUPAC2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine
SMILESCC(CN)N1CCC(CCN(C)C)CC1
InChIInChI=1S/C12H27N3/c1-11(10-13)15-8-5-12(6-9-15)4-7-14(2)3/h11-12H,4-10,13H2,1-3H3
InChIKeyAUJQWRFQIFBMLS-UHFFFAOYSA-N
MW213.37 g/mol
LogP1.00
Rot. Bonds5

About 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine

2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine (PubChem CID 83835390) has the molecular formula C12H27N3 and a molecular weight of 213.37 g/mol. Its IUPAC name is 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine.

Molecular Properties

Compound Name2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine
PubChem CID83835390
Molecular FormulaC12H27N3
Molecular Weight213.37 g/mol
Exact Mass213.22
IUPAC Name2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine
SMILESCC(CN)N1CCC(CCN(C)C)CC1
InChIInChI=1S/C12H27N3/c1-11(10-13)15-8-5-12(6-9-15)4-7-14(2)3/h11-12H,4-10,13H2,1-3H3
InChIKeyAUJQWRFQIFBMLS-UHFFFAOYSA-N
XLogP1.00
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-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

1-(1-aminopropan-2-yl)-N-cyclopropyl-N-methylpiperidin-4-amine
CID 83835132
N,N-dimethyl-2-[1-(1-phenylethyl)piperidin-4-yl]ethanamine
CID 60542956
N',2-dimethyl-N'-[2-(1-methylpiperidin-4-yl)ethyl]propane-1,3-diamine
CID 115198906
1-[1-(1-aminopropan-2-yl)piperidin-4-yl]ethanol
CID 106835616
N-ethyl-N-methyl-2-(1-propan-2-ylpiperidin-4-yl)ethanamine
CID 176717350
2-[3-(aminomethyl)pyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
CID 115492059
2-(4-benzylpiperidin-1-yl)propan-1-amine
CID 16642433
4-[2-(dimethylamino)ethyl]piperidine-1-carbaldehyde
CID 87381497
2-(4-pentan-2-ylpiperazin-1-yl)propan-1-amine
CID 107895642
N-propan-2-yl-2-(4-propylpiperidin-1-yl)propan-1-amine
CID 62439844
2-[4-(cyclopentylmethyl)piperazin-1-yl]propan-1-amine
CID 63339559
N,N-dimethyl-1-[1-(3-methylbutan-2-yl)piperidin-4-yl]methanamine
CID 146262261

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine?
The IUPAC name of 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine (CID 83835390) is 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine.
What is the SMILES notation for 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine?
The canonical SMILES for 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine is CC(CN)N1CCC(CCN(C)C)CC1.
What is the InChIKey of 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine?
The InChIKey is AUJQWRFQIFBMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3/c1-11(10-13)15-8-5-12(6-9-15)4-7-14(2)3/h11-12H,4-10,13H2,1-3H3.
What are the key properties of 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine?
2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine has a molecular weight of 213.37 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]propan-1-amine is sourced from PubChem (CID 83835390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).