2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide

C12H26N2O2 — CID 83176935

IUPAC2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NC(C)CCO
InChIInChI=1S/C12H26N2O2/c1-6-12(4,5)14-11(16)10(3)13-9(2)7-8-15/h9-10,13,15H,6-8H2,1-5H3,(H,14,16)
InChIKeySQBXFMCZYCSPKC-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.04
Rot. Bonds7

About 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide

2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide (PubChem CID 83176935) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
PubChem CID83176935
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NC(C)CCO
InChIInChI=1S/C12H26N2O2/c1-6-12(4,5)14-11(16)10(3)13-9(2)7-8-15/h9-10,13,15H,6-8H2,1-5H3,(H,14,16)
InChIKeySQBXFMCZYCSPKC-UHFFFAOYSA-N
XLogP1.04
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(diethylamino)pentan-2-ylamino]-N-(2-methylbutan-2-yl)propanamide
CID 43113172
2-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-N-(2-methylbutan-2-yl)propanamide
CID 54950380
N-ethyl-2-(4-hydroxybutan-2-ylamino)propanamide
CID 83177660
N-(2-methylbutan-2-yl)-2-(2-methylbutan-2-ylamino)propanamide
CID 43116529
2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43416442
2-(ethylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43112409
N-(2-methylbutan-2-yl)-2-(3-methylbutylamino)propanamide
CID 43112990
N-(2-methylbutan-2-yl)-2-(1-phenylethylamino)propanamide
CID 43113751
2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 60720233
N-(2-methylbutan-2-yl)-2-(3-methylbut-2-enylamino)propanamide
CID 103520478
2-(1-cyclopropylbutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
CID 63995136
2-[[2-(diethylamino)-2-oxoethyl]amino]-N-(2-methylbutan-2-yl)propanamide
CID 112687061

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide (CID 83176935) is 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)NC(C)CCO.
What is the InChIKey of 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is SQBXFMCZYCSPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-6-12(4,5)14-11(16)10(3)13-9(2)7-8-15/h9-10,13,15H,6-8H2,1-5H3,(H,14,16).
What are the key properties of 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide?
2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 230.35 g/mol, XLogP of 1.04, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 83176935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).