(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide

C14H29N3O2 — CID 119868946

IUPAC(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide
SMILESCC(C)C[C@H](N)C(=O)NCCN1CCOC(C)(C)C1
InChIInChI=1S/C14H29N3O2/c1-11(2)9-12(15)13(18)16-5-6-17-7-8-19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18)/t12-/m0/s1
InChIKeyAKHNKLNIZVSUHO-LBPRGKRZSA-N
MW271.40 g/mol
LogP0.59
Rot. Bonds6

About (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide

(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide (PubChem CID 119868946) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide
PubChem CID119868946
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide
SMILESCC(C)C[C@H](N)C(=O)NCCN1CCOC(C)(C)C1
InChIInChI=1S/C14H29N3O2/c1-11(2)9-12(15)13(18)16-5-6-17-7-8-19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18)/t12-/m0/s1
InChIKeyAKHNKLNIZVSUHO-LBPRGKRZSA-N
XLogP0.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

LM11A-31
CID 18604758
Morpholine-4-carboxylic acid [1-(cyanomethyl-carbamoyl)-3-methyl-butyl]-amide
CID 11098017
2-amino-3-methyl-N-[2-(morpholin-4-yl)ethyl]pentanamide
CID 11959372
2-Propyl-pentanoic acid (2-morpholin-4-yl-ethyl)-amide
CID 6602917
(2S)-2-[[(2S)-2-[acetyl(3-ethoxypropyl)amino]-4-methylpentanoyl]amino]-4-methyl-N-(2-morpholin-4-ylethyl)pentanamide
CID 45273241
2-Amino-4-methyl-1-(morpholin-4-YL)pentan-1-one
CID 21355341
2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide dihydrochloride
CID 43810708
(2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one
CID 14963842
Morpholine-4-carboxylic acid (3-methyl-1-prop-2-ynylcarbamoyl-butyl)-amide
CID 10858935
tert-butyl (2S)-2-isobutyl-3-oxo-piperazine-1-carboxylate
CID 44350335
(2S)-2-[[2-[acetyl(3-ethoxypropyl)amino]-4-methylpentanoyl]amino]-4-methyl-N-(2-morpholin-4-ylethyl)pentanamide
CID 45272368
N-(1-methoxypropan-2-yl)-2-(4-methylpiperidin-1-yl)acetamide
CID 45796799

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide (CID 119868946) is (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide is CC(C)C[C@H](N)C(=O)NCCN1CCOC(C)(C)C1.
What is the InChIKey of (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide?
The InChIKey is AKHNKLNIZVSUHO-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-11(2)9-12(15)13(18)16-5-6-17-7-8-19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18)/t12-/m0/s1.
What are the key properties of (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide?
(2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide has a molecular weight of 271.40 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-methylpentanamide is sourced from PubChem (CID 119868946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).