1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide

C9H18N4O2 — CID 82508838

IUPAC1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide
SMILESNCCNC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C9H18N4O2/c10-3-4-12-9(15)13-5-1-7(2-6-13)8(11)14/h7H,1-6,10H2,(H2,11,14)(H,12,15)
InChIKeyBIQYQOLYWQQQDG-UHFFFAOYSA-N
MW214.27 g/mol
LogP-1.15
Rot. Bonds3

About 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide

1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide (PubChem CID 82508838) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide
PubChem CID82508838
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC Name1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide
SMILESNCCNC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C9H18N4O2/c10-3-4-12-9(15)13-5-1-7(2-6-13)8(11)14/h7H,1-6,10H2,(H2,11,14)(H,12,15)
InChIKeyBIQYQOLYWQQQDG-UHFFFAOYSA-N
XLogP-1.15
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-[2-(cyclopropanecarbonylamino)ethyl]piperidine-1,4-dicarboxamide
CID 47127704
4-[(4-carbamoylpiperidine-1-carbonyl)amino]-2-methylbutanoic acid
CID 80540176
5-[(4-carbamoylpiperidine-1-carbonyl)amino]-2-methylpentanoic acid
CID 104686059
N-(2-aminoethyl)-4-cyclopropylpiperazine-1-carboxamide
CID 82508516
tert-butyl N-[2-[(4-carbamoylpiperidine-1-carbonyl)amino]ethyl]-N-ethylcarbamate
CID 56826198
4-(N'-hydroxycarbamimidoyl)-N-propylpiperidine-1-carboxamide
CID 77039009
1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide
CID 71897846
1-N-[3-(4-methoxyphenoxy)propyl]piperidine-1,4-dicarboxamide
CID 56798865
N-(2-aminoethyl)-1-methylpiperidine-4-carboxamide
CID 53215741
(3R)-1-N-[2-(trifluoromethylsulfanyl)ethyl]pyrrolidine-1,3-dicarboxamide
CID 99773480
1-N-(2-naphthalen-1-yloxyethyl)piperidine-1,4-dicarboxamide
CID 56797933
1-(2-chloroethylcarbamoyl)piperidine-4-carboxylic acid
CID 16769941

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide (CID 82508838) is 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide is NCCNC(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide?
The InChIKey is BIQYQOLYWQQQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2/c10-3-4-12-9(15)13-5-1-7(2-6-13)8(11)14/h7H,1-6,10H2,(H2,11,14)(H,12,15).
What are the key properties of 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide?
1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide has a molecular weight of 214.27 g/mol, XLogP of -1.15, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 82508838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).