2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide

C14H29N3O — CID 62976128

IUPAC2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NCCN(C)C1CC1
InChIInChI=1S/C14H29N3O/c1-5-6-11(2)16-14(18)12(3)15-9-10-17(4)13-7-8-13/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyATIFRPDLJZXDOI-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.36
Rot. Bonds9

About 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide

2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide (PubChem CID 62976128) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide
PubChem CID62976128
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NCCN(C)C1CC1
InChIInChI=1S/C14H29N3O/c1-5-6-11(2)16-14(18)12(3)15-9-10-17(4)13-7-8-13/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyATIFRPDLJZXDOI-UHFFFAOYSA-N
XLogP1.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-propylpropanamide
CID 62976116
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-methylpropanamide
CID 62976125
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentylpropanamide
CID 55140066
2-[2-[di(propan-2-yl)amino]ethylamino]-N-pentan-2-ylpropanamide
CID 43113241
2-[2-(diethylamino)ethylamino]-N-pentan-2-ylpropanamide
CID 43112761
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N,N-dimethylpropanamide
CID 62977771
ethyl 2-[2-[cyclopentyl(methyl)amino]ethylamino]propanoate
CID 63318117
N'-cyclopropyl-N-heptan-4-yl-N'-methylethane-1,2-diamine
CID 62974974
(2S)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]pentanamide
CID 107569640
N'-methyl-N'-(oxan-4-yl)-N-pentan-2-ylethane-1,2-diamine
CID 62561007
2-(4-methylpentylamino)-N-pentan-2-ylpropanamide
CID 60745937
2-[2-[cyclopentyl(methyl)amino]ethylamino]-N,N-dimethylpropanamide
CID 63318305

Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The IUPAC name of 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide (CID 62976128) is 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)NCCN(C)C1CC1.
What is the InChIKey of 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide?
The InChIKey is ATIFRPDLJZXDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-6-11(2)16-14(18)12(3)15-9-10-17(4)13-7-8-13/h11-13,15H,5-10H2,1-4H3,(H,16,18).
What are the key properties of 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide?
2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide has a molecular weight of 255.41 g/mol, XLogP of 1.36, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopropyl(methyl)amino]ethylamino]-N-pentan-2-ylpropanamide is sourced from PubChem (CID 62976128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).