N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide

C9H18N4O2 — CID 63301604

IUPACN-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide
SMILESCC(C(=O)NC(N)=O)N(C)C1CCNC1
InChIInChI=1S/C9H18N4O2/c1-6(8(14)12-9(10)15)13(2)7-3-4-11-5-7/h6-7,11H,3-5H2,1-2H3,(H3,10,12,14,15)
InChIKeyOJBNBDWTLVVCGP-UHFFFAOYSA-N
MW214.27 g/mol
LogP-1.14
Rot. Bonds3

About N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide

N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide (PubChem CID 63301604) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide
PubChem CID63301604
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC NameN-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide
SMILESCC(C(=O)NC(N)=O)N(C)C1CCNC1
InChIInChI=1S/C9H18N4O2/c1-6(8(14)12-9(10)15)13(2)7-3-4-11-5-7/h6-7,11H,3-5H2,1-2H3,(H3,10,12,14,15)
InChIKeyOJBNBDWTLVVCGP-UHFFFAOYSA-N
XLogP-1.14
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[azetidin-3-yl(methyl)amino]-N-carbamoylpropanamide
CID 66188069
N-(methylcarbamoyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
CID 63301559
ethyl 2-[methyl(pyrrolidin-3-yl)amino]propanoate
CID 63301878
2-[(4-aminocyclohexyl)-methylamino]-N-carbamoylpropanamide
CID 79121744
N-methyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 63643925
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-carbamoylpropanamide
CID 61231473
N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
CID 63301691
methyl 2-methyl-3-[methyl(pyrrolidin-3-yl)amino]butanoate
CID 79414659
N-tert-butyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 63644074
N-ethyl-2-[methyl(piperidin-4-yl)amino]propanamide
CID 43607766
2-[azetidin-3-yl(methyl)amino]propanamide
CID 66188290
(3S)-N-methyl-N-propan-2-ylpyrrolidin-3-amine;dihydrochloride
CID 138393817

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The IUPAC name of N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide (CID 63301604) is N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide.
What is the SMILES notation for N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The canonical SMILES for N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide is CC(C(=O)NC(N)=O)N(C)C1CCNC1.
What is the InChIKey of N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The InChIKey is OJBNBDWTLVVCGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2/c1-6(8(14)12-9(10)15)13(2)7-3-4-11-5-7/h6-7,11H,3-5H2,1-2H3,(H3,10,12,14,15).
What are the key properties of N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide has a molecular weight of 214.27 g/mol, XLogP of -1.14, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide is sourced from PubChem (CID 63301604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).