6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide

C14H29N3O — CID 65291228

IUPAC6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)NCCN(C)C1CC1
InChIInChI=1S/C14H29N3O/c1-11(5-4-6-12(2)15)14(18)16-9-10-17(3)13-7-8-13/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyFWSJESBTGHEPRY-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds9

About 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide

6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide (PubChem CID 65291228) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide.

Molecular Properties

Compound Name6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide
PubChem CID65291228
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)NCCN(C)C1CC1
InChIInChI=1S/C14H29N3O/c1-11(5-4-6-12(2)15)14(18)16-9-10-17(3)13-7-8-13/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyFWSJESBTGHEPRY-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 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 ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylpentanamide
CID 113441005
(2S)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]pentanamide
CID 107569640
(2S,3S)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3-methylpentanamide
CID 62975934
6-amino-2-methyl-N-propylheptanamide
CID 65292773
6-amino-2-methyl-N-(3-methylbutyl)heptanamide
CID 65293191
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3,3-dimethylbutanamide
CID 76979692
(2S)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3,3-dimethylbutanamide;dihydrochloride
CID 119863863
6-amino-N-[2-(carbamoylamino)ethyl]-2-methylheptanamide
CID 83109295
6-amino-2-methyl-N-pentylheptanamide
CID 65292783
6-amino-N-(4-hydroxybutyl)-2-methylheptanamide
CID 106841939
3-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3-hydroxyimino-2-methylpropanamide
CID 76979808
2-carbamothioyl-N-[2-[cyclopropyl(methyl)amino]ethyl]-3-methylbutanamide
CID 55139681

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide?
The IUPAC name of 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide (CID 65291228) is 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide.
What is the SMILES notation for 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide?
The canonical SMILES for 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide is CC(N)CCCC(C)C(=O)NCCN(C)C1CC1.
What is the InChIKey of 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide?
The InChIKey is FWSJESBTGHEPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(5-4-6-12(2)15)14(18)16-9-10-17(3)13-7-8-13/h11-13H,4-10,15H2,1-3H3,(H,16,18).
What are the key properties of 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide?
6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide is sourced from PubChem (CID 65291228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).