2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide

C10H21N3O2 — CID 62117084

IUPAC2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide
SMILESCCCC(CC)NC(=O)CNC(=O)CN
InChIInChI=1S/C10H21N3O2/c1-3-5-8(4-2)13-10(15)7-12-9(14)6-11/h8H,3-7,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyKMUKZHIXMDELQK-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.24
Rot. Bonds7

About 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide

2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide (PubChem CID 62117084) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide
PubChem CID62117084
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide
SMILESCCCC(CC)NC(=O)CNC(=O)CN
InChIInChI=1S/C10H21N3O2/c1-3-5-8(4-2)13-10(15)7-12-9(14)6-11/h8H,3-7,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyKMUKZHIXMDELQK-UHFFFAOYSA-N
XLogP-0.24
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-hydroxypentan-3-ylamino)-2-oxoethyl]butanamide
CID 109479267
2-amino-N-[2-oxo-2-(pent-1-yn-3-ylamino)ethyl]acetamide
CID 106230441
2-amino-N-[(6R)-6-[(2-aminoacetyl)amino]octyl]acetamide
CID 160835672
2-amino-N-(1-methylsulfanylpentan-3-yl)acetamide
CID 58388308
2-(2-aminoethoxy)-N-hexan-3-ylacetamide
CID 79478574
2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-methylpentanoic acid
CID 4182583
methyl 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-methylpentanoate
CID 60851923
2-[[[2-[(2-aminoacetyl)amino]acetyl]amino]methyl]pentanoic acid
CID 65224048
7-amino-N-hexan-3-ylheptanamide;hydrochloride
CID 119757664
methyl 2-[[2-[(2-aminoacetyl)amino]acetyl]-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(pentan-3-ylamino)ethyl]amino]ethyl]amino]ethyl]amino]acetate
CID 145085652
4-(hexan-3-ylamino)-4-oxobutanoic acid
CID 62118536
hexan-3-ylurea;molecular hydrogen
CID 143768672

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide (CID 62117084) is 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide is CCCC(CC)NC(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide?
The InChIKey is KMUKZHIXMDELQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-3-5-8(4-2)13-10(15)7-12-9(14)6-11/h8H,3-7,11H2,1-2H3,(H,12,14)(H,13,15).
What are the key properties of 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide?
2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide has a molecular weight of 215.30 g/mol, XLogP of -0.24, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 62117084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).