N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide

C12H26N4O2 — CID 43086354

IUPACN-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide
SMILESCC(NCCN(C(C)C)C(C)C)C(=O)NC(N)=O
InChIInChI=1S/C12H26N4O2/c1-8(2)16(9(3)4)7-6-14-10(5)11(17)15-12(13)18/h8-10,14H,6-7H2,1-5H3,(H3,13,15,17,18)
InChIKeyWMUXXVCYXGAJBK-UHFFFAOYSA-N
MW258.37 g/mol
LogP0.28
Rot. Bonds7

About N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide

N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide (PubChem CID 43086354) has the molecular formula C12H26N4O2 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide
PubChem CID43086354
Molecular FormulaC12H26N4O2
Molecular Weight258.37 g/mol
Exact Mass258.21
IUPAC NameN-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide
SMILESCC(NCCN(C(C)C)C(C)C)C(=O)NC(N)=O
InChIInChI=1S/C12H26N4O2/c1-8(2)16(9(3)4)7-6-14-10(5)11(17)15-12(13)18/h8-10,14H,6-7H2,1-5H3,(H3,13,15,17,18)
InChIKeyWMUXXVCYXGAJBK-UHFFFAOYSA-N
XLogP0.28
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-carbamoyl-2-[3-[methyl(propan-2-yl)amino]propylamino]propanamide
CID 106045951
N-carbamoyl-2-[3-(dimethylamino)propylamino]propanamide
CID 43086025
2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide
CID 43113241
N-carbamoyl-2-(3-hydroxypropylamino)propanamide
CID 43392786
N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]acetamide
CID 28568651
2-[2-[di(propan-2-yl)amino]ethylamino]-N-(3-methoxypropyl)propanamide
CID 43113238
4-[[1-(carbamoylamino)-1-oxopropan-2-yl]amino]butanoic acid
CID 43473366
methyl 3-[[1-(carbamoylamino)-1-oxopropan-2-yl]amino]propanoate
CID 60672495
N-carbamoyl-2-[3-hydroxypropyl(propan-2-yl)amino]propanamide
CID 62021615
N-carbamoyl-2-(2,3-dimethylbutylamino)propanamide
CID 64569124
N-carbamoyl-2-(methylamino)propanamide
CID 43086023
ethyl 4-[[1-(carbamoylamino)-1-oxopropan-2-yl]amino]butanoate
CID 60671920

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide?
The IUPAC name of N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide (CID 43086354) is N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide.
What is the SMILES notation for N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide?
The canonical SMILES for N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide is CC(NCCN(C(C)C)C(C)C)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide?
The InChIKey is WMUXXVCYXGAJBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O2/c1-8(2)16(9(3)4)7-6-14-10(5)11(17)15-12(13)18/h8-10,14H,6-7H2,1-5H3,(H3,13,15,17,18).
What are the key properties of N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide?
N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide has a molecular weight of 258.37 g/mol, XLogP of 0.28, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]propanamide is sourced from PubChem (CID 43086354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).