N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide

C14H24N4O — CID 21354456

IUPACN,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide
SMILESCCCN(CCC)CC(=O)N(CCC#N)CCC#N
InChIInChI=1S/C14H24N4O/c1-3-9-17(10-4-2)13-14(19)18(11-5-7-15)12-6-8-16/h3-6,9-13H2,1-2H3
InChIKeyCKIQCCOYZDOUBK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.76
Rot. Bonds10

About N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide

N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide (PubChem CID 21354456) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide.

Molecular Properties

Compound NameN,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide
PubChem CID21354456
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide
SMILESCCCN(CCC)CC(=O)N(CCC#N)CCC#N
InChIInChI=1S/C14H24N4O/c1-3-9-17(10-4-2)13-14(19)18(11-5-7-15)12-6-8-16/h3-6,9-13H2,1-2H3
InChIKeyCKIQCCOYZDOUBK-UHFFFAOYSA-N
XLogP1.76
TPSA71.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis(2-cyanoethyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78962384
2-[2-cyanoethyl(propyl)amino]acetic acid
CID 62962287
N,N,N',N'-tetrakis(2-cyanoethyl)butanediamide
CID 15084880
N,N-bis(2-cyanoethyl)dodecanamide
CID 3396127
ethyl 2-[[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]-methylamino]acetate
CID 62011813
2-[[2-[bis(2-cyanoethyl)amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78826448
2-[bis[2-(dipropylamino)-2-oxoethyl]amino]acetic acid
CID 138501380
2-cyanoethyl(ethyl)carbamic acid
CID 18786016
N,N-bis(2-cyanoethyl)-2-[cyclohexyl(methyl)amino]acetamide
CID 86910482
2-bromo-N-(2-cyanoethyl)-N-(2-methoxyethyl)acetamide
CID 63681268
3-amino-N,N-bis(2-cyanoethyl)propanamide
CID 60953472
N-(2-cyanoethyl)-N-ethylheptanamide
CID 115610951

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide?
The IUPAC name of N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide (CID 21354456) is N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide.
What is the SMILES notation for N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide?
The canonical SMILES for N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide is CCCN(CCC)CC(=O)N(CCC#N)CCC#N.
What is the InChIKey of N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide?
The InChIKey is CKIQCCOYZDOUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-9-17(10-4-2)13-14(19)18(11-5-7-15)12-6-8-16/h3-6,9-13H2,1-2H3.
What are the key properties of N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide?
N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.76, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-cyanoethyl)-2-(dipropylamino)acetamide is sourced from PubChem (CID 21354456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).