(2S)-2-amino-N-cyclopropyl-N-propylhexanamide

C12H24N2O — CID 103950188

IUPAC(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
SMILESCCCC[C@H](N)C(=O)N(CCC)C1CC1
InChIInChI=1S/C12H24N2O/c1-3-5-6-11(13)12(15)14(9-4-2)10-7-8-10/h10-11H,3-9,13H2,1-2H3/t11-/m0/s1
InChIKeyRTVMURYSMUCIQT-NSHDSACASA-N
MW212.34 g/mol
LogP1.90
Rot. Bonds7

About (2S)-2-amino-N-cyclopropyl-N-propylhexanamide

(2S)-2-amino-N-cyclopropyl-N-propylhexanamide (PubChem CID 103950188) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (2S)-2-amino-N-cyclopropyl-N-propylhexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
PubChem CID103950188
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
SMILESCCCC[C@H](N)C(=O)N(CCC)C1CC1
InChIInChI=1S/C12H24N2O/c1-3-5-6-11(13)12(15)14(9-4-2)10-7-8-10/h10-11H,3-9,13H2,1-2H3/t11-/m0/s1
InChIKeyRTVMURYSMUCIQT-NSHDSACASA-N
XLogP1.90
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-cyclopropyl-N-(2-hydroxyethyl)hexanamide
CID 103951026
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide
CID 54873886
(2S)-2-amino-N-cyclopentyl-N-(3-methylbutyl)hexanamide
CID 103831497
2-amino-N-cyclopropyl-4-methyl-N-propylpentanamide
CID 43270485
2-amino-N-butyl-N-(1,1-dioxothiolan-3-yl)hexanamide
CID 60940048
2-amino-N-butyl-N-cyclopropyl-3-methoxypropanamide
CID 81082508
2-amino-N-cyclopropyl-N-(2-methoxyethyl)pentanamide
CID 60947244
(2R)-2-amino-N-butyl-N-cyclopropyl-4-methylpentanamide
CID 104903070
(2R)-2-amino-N-cyclopropyl-3-methyl-N-propylbutanamide
CID 79011597
(2S)-2-amino-N-cyclopentyl-N-methylhexanamide
CID 103831134
(2S)-2-amino-N,N-bis(cyclopropylmethyl)hexanamide
CID 113304824
2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide
CID 60944592

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-cyclopropyl-N-propylhexanamide?
The IUPAC name of (2S)-2-amino-N-cyclopropyl-N-propylhexanamide (CID 103950188) is (2S)-2-amino-N-cyclopropyl-N-propylhexanamide.
What is the SMILES notation for (2S)-2-amino-N-cyclopropyl-N-propylhexanamide?
The canonical SMILES for (2S)-2-amino-N-cyclopropyl-N-propylhexanamide is CCCC[C@H](N)C(=O)N(CCC)C1CC1.
What is the InChIKey of (2S)-2-amino-N-cyclopropyl-N-propylhexanamide?
The InChIKey is RTVMURYSMUCIQT-NSHDSACASA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-5-6-11(13)12(15)14(9-4-2)10-7-8-10/h10-11H,3-9,13H2,1-2H3/t11-/m0/s1.
What are the key properties of (2S)-2-amino-N-cyclopropyl-N-propylhexanamide?
(2S)-2-amino-N-cyclopropyl-N-propylhexanamide has a molecular weight of 212.34 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-cyclopropyl-N-propylhexanamide is sourced from PubChem (CID 103950188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).