(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide

C15H31N3O — CID 97087184

IUPAC(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide
SMILESCCC(C)(C)NC(=O)[C@@H](C)N(C)CCN1CCCC1
InChIInChI=1S/C15H31N3O/c1-6-15(3,4)16-14(19)13(2)17(5)11-12-18-9-7-8-10-18/h13H,6-12H2,1-5H3,(H,16,19)/t13-/m1/s1
InChIKeyQYUIDNONOSYADH-CYBMUJFWSA-N
MW269.43 g/mol
LogP1.71
Rot. Bonds7

About (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide

(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide (PubChem CID 97087184) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide.

Molecular Properties

Compound Name(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide
PubChem CID97087184
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide
SMILESCCC(C)(C)NC(=O)[C@@H](C)N(C)CCN1CCCC1
InChIInChI=1S/C15H31N3O/c1-6-15(3,4)16-14(19)13(2)17(5)11-12-18-9-7-8-10-18/h13H,6-12H2,1-5H3,(H,16,19)/t13-/m1/s1
InChIKeyQYUIDNONOSYADH-CYBMUJFWSA-N
XLogP1.71
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[methyl-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]propanoic acid;hydrochloride
CID 119911897
2-[5-aminopentyl(methyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 107207248
N-(2-methylbutan-2-yl)-2-[methyl-(2-oxo-2-piperazin-1-ylethyl)amino]propanamide
CID 61018696
2-methyl-2-[[methyl(2-pyrrolidin-1-ylethyl)carbamoyl]amino]butanoic acid
CID 79800918
N-(2-methylbutan-2-yl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 24842768
2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-ol
CID 115773280
N-butyl-2-[methyl(2-piperazin-1-ylethyl)amino]propanamide
CID 63266204
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 63760066
2-[1-aminopropan-2-yl(methyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 104556787
2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methylbutan-2-yl)propanamide
CID 47145321
2-(3-amino-N-methylanilino)-N-(2-methylbutan-2-yl)propanamide
CID 61296584
2-methyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]-2-(propan-2-ylamino)propanoic acid
CID 63211201

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide?
The IUPAC name of (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide (CID 97087184) is (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide.
What is the SMILES notation for (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide?
The canonical SMILES for (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide is CCC(C)(C)NC(=O)[C@@H](C)N(C)CCN1CCCC1.
What is the InChIKey of (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide?
The InChIKey is QYUIDNONOSYADH-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H31N3O/c1-6-15(3,4)16-14(19)13(2)17(5)11-12-18-9-7-8-10-18/h13H,6-12H2,1-5H3,(H,16,19)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide?
(2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide has a molecular weight of 269.43 g/mol, XLogP of 1.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-methylbutan-2-yl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propanamide is sourced from PubChem (CID 97087184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).