N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide

C13H25N3O2 — CID 119756291

IUPACN-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide
SMILESCCC(C)NC(=O)C(C)NC(=O)CNCC1CC1
InChIInChI=1S/C13H25N3O2/c1-4-9(2)15-13(18)10(3)16-12(17)8-14-7-11-5-6-11/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyNRYHZKFAQIHOMH-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.41
Rot. Bonds8

About N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide

N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide (PubChem CID 119756291) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide
PubChem CID119756291
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide
SMILESCCC(C)NC(=O)C(C)NC(=O)CNCC1CC1
InChIInChI=1S/C13H25N3O2/c1-4-9(2)15-13(18)10(3)16-12(17)8-14-7-11-5-6-11/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyNRYHZKFAQIHOMH-UHFFFAOYSA-N
XLogP0.41
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[[2-(2-methoxyethylamino)acetyl]amino]propanamide;hydrochloride
CID 119756312
methyl (2R)-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanoate;hydrochloride
CID 119781285
2-(cyclopropylmethylamino)-N-(1-hydroxypropan-2-yl)acetamide
CID 60841587
2-(cyclopropylmethylamino)-N-(4-methoxybutan-2-yl)acetamide
CID 64606071
methyl 2-[[2-(cyclopropylmethylamino)acetyl]amino]butanoate
CID 119709040
2-(cyclohexylmethylamino)-N-pentan-2-ylacetamide
CID 60687215
N-[1-(butan-2-ylamino)-1-oxopropan-2-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110014350
N-butan-2-yl-2-[2-(cyclopropylmethoxy)ethylamino]propanamide
CID 113233538
N-[(2S)-butan-2-yl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 28585328
N-[1-(butan-2-ylamino)-1-oxopropan-2-yl]pentanamide
CID 60597163
2-[(4-hydroxycyclohexyl)methylamino]-N-(3-methylbutan-2-yl)acetamide
CID 106133186
N-butan-2-yl-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 71944060

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide?
The IUPAC name of N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide (CID 119756291) is N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide.
What is the SMILES notation for N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide?
The canonical SMILES for N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide is CCC(C)NC(=O)C(C)NC(=O)CNCC1CC1.
What is the InChIKey of N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide?
The InChIKey is NRYHZKFAQIHOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-9(2)15-13(18)10(3)16-12(17)8-14-7-11-5-6-11/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17).
What are the key properties of N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide?
N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide has a molecular weight of 255.36 g/mol, XLogP of 0.41, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[[2-(cyclopropylmethylamino)acetyl]amino]propanamide is sourced from PubChem (CID 119756291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).