N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide

C12H26N2O — CID 43087379

IUPACN-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide
SMILESCCCC(C)NC(C)C(=O)NCC(C)C
InChIInChI=1S/C12H26N2O/c1-6-7-10(4)14-11(5)12(15)13-8-9(2)3/h9-11,14H,6-8H2,1-5H3,(H,13,15)
InChIKeyZLPCXEJNKGSWRA-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.93
Rot. Bonds7

About N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide

N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide (PubChem CID 43087379) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide
PubChem CID43087379
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide
SMILESCCCC(C)NC(C)C(=O)NCC(C)C
InChIInChI=1S/C12H26N2O/c1-6-7-10(4)14-11(5)12(15)13-8-9(2)3/h9-11,14H,6-8H2,1-5H3,(H,13,15)
InChIKeyZLPCXEJNKGSWRA-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-2-(heptan-2-ylamino)propanamide
CID 54950626
2-(3-methylbutan-2-ylamino)-N-(2-methylpropyl)propanamide
CID 43087775
2-(3-methylpentan-2-ylamino)-N-(2-methylpropyl)propanamide
CID 61463653
2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
CID 62201162
N-(3-methylbutyl)-2-(octan-2-ylamino)propanamide
CID 61476708
N-ethyl-2-(4-hydroxybutan-2-ylamino)propanamide
CID 83177660
2-(octan-2-ylamino)-N-pentylpropanamide
CID 61476673
(2S)-2-[[1-(2-methylpropylamino)-1-oxopropan-2-yl]carbamoylamino]pentanoic acid
CID 107567519
oxalic acid;N-propan-2-ylpentan-2-amine
CID 175913447
2-(3-methylbutylamino)-N-(2-methylpropyl)propanamide
CID 43086968
2-(butylcarbamothioylamino)-N-(2-methylpropyl)propanamide
CID 116509936
2-(pentan-2-ylamino)-N-phenylpropanamide
CID 43083650

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide?
The IUPAC name of N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide (CID 43087379) is N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide is CCCC(C)NC(C)C(=O)NCC(C)C.
What is the InChIKey of N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide?
The InChIKey is ZLPCXEJNKGSWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-6-7-10(4)14-11(5)12(15)13-8-9(2)3/h9-11,14H,6-8H2,1-5H3,(H,13,15).
What are the key properties of N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide?
N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide has a molecular weight of 214.35 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide is sourced from PubChem (CID 43087379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).