3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide

C10H22N2O3 — CID 106112962

IUPAC3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide
SMILESCCCC(COC)NC(=O)C(CN)OC
InChIInChI=1S/C10H22N2O3/c1-4-5-8(7-14-2)12-10(13)9(6-11)15-3/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyFIPXPMUWIJPPKC-UHFFFAOYSA-N
MW218.30 g/mol
LogP-0.11
Rot. Bonds8

About 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide

3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide (PubChem CID 106112962) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide.

Molecular Properties

Compound Name3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide
PubChem CID106112962
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Name3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide
SMILESCCCC(COC)NC(=O)C(CN)OC
InChIInChI=1S/C10H22N2O3/c1-4-5-8(7-14-2)12-10(13)9(6-11)15-3/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyFIPXPMUWIJPPKC-UHFFFAOYSA-N
XLogP-0.11
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(1-methoxypentan-2-yl)butanamide
CID 79023147
N-(1-methoxypentan-2-yl)-2-sulfanylpropanamide
CID 107030746
methyl N-(1-methoxypentan-2-yl)carbamate
CID 116656283
2-[(3-amino-2-methoxypropanoyl)amino]hexanoic acid
CID 106112321
(2S)-2-[(3-amino-2-methoxypropanoyl)amino]hexanoic acid
CID 106114110
ethyl N-(1-methoxypentan-2-yl)carbamate
CID 64590516
2-amino-2-ethyl-N-(1-methoxypentan-2-yl)butanamide
CID 79813031
2-[(3-amino-2-methoxypropanoyl)amino]-5-methoxypentanoic acid
CID 114145147
(2S)-2-[(3-amino-2-methoxypropanoyl)amino]butanoic acid
CID 106113366
(2S)-2-amino-N-(4-hydroxy-1-methoxybutan-2-yl)pentanamide
CID 106161059
2-[[(3-amino-2-methoxypropanoyl)amino]methyl]pentanoic acid
CID 106113025
N-(1-amino-3-methoxypropan-2-yl)-2-ethylhexanamide
CID 106180051

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide?
The IUPAC name of 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide (CID 106112962) is 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide.
What is the SMILES notation for 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide?
The canonical SMILES for 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide is CCCC(COC)NC(=O)C(CN)OC.
What is the InChIKey of 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide?
The InChIKey is FIPXPMUWIJPPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-4-5-8(7-14-2)12-10(13)9(6-11)15-3/h8-9H,4-7,11H2,1-3H3,(H,12,13).
What are the key properties of 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide?
3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide has a molecular weight of 218.30 g/mol, XLogP of -0.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide is sourced from PubChem (CID 106112962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).