4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide

C15H32N4O — CID 66431891

IUPAC4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)CCN1CCCC1
InChIInChI=1S/C15H32N4O/c1-4-19(5-2)15(20)12-14(13-16)17(3)10-11-18-8-6-7-9-18/h14H,4-13,16H2,1-3H3
InChIKeyCWAFEJNOIBPKLB-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.60
Rot. Bonds9

About 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide

4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide (PubChem CID 66431891) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide
PubChem CID66431891
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)CCN1CCCC1
InChIInChI=1S/C15H32N4O/c1-4-19(5-2)15(20)12-14(13-16)17(3)10-11-18-8-6-7-9-18/h14H,4-13,16H2,1-3H3
InChIKeyCWAFEJNOIBPKLB-UHFFFAOYSA-N
XLogP0.60
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[2,2-dimethylpropyl(methyl)amino]-N,N-diethylbutanamide
CID 66432910
2-N-methyl-2-N-(2-pyrrolidin-1-ylethyl)octane-1,2-diamine
CID 63206770
4-amino-N,N-diethyl-3-[methyl(2-phenylethyl)amino]butanamide
CID 66432918
N,N-diethyl-3-piperidin-1-ylpropanamide
CID 110688324
4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
CID 103155857
2-N-methyl-3-phenyl-2-N-(2-pyrrolidin-1-ylethyl)propane-1,2-diamine
CID 63207033
4-amino-3-[butan-2-yl(ethyl)amino]-N,N-diethylbutanamide
CID 66431882
4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
CID 66430451
2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-ol
CID 115773280
4-amino-N,N-diethyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66431686
1-cyclopropyl-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63206854
2-[ethyl-[methyl(2-pyrrolidin-1-ylethyl)carbamoyl]amino]acetic acid
CID 63208770

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide?
The IUPAC name of 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide (CID 66431891) is 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide.
What is the SMILES notation for 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide?
The canonical SMILES for 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide is CCN(CC)C(=O)CC(CN)N(C)CCN1CCCC1.
What is the InChIKey of 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide?
The InChIKey is CWAFEJNOIBPKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-4-19(5-2)15(20)12-14(13-16)17(3)10-11-18-8-6-7-9-18/h14H,4-13,16H2,1-3H3.
What are the key properties of 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide?
4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide has a molecular weight of 284.45 g/mol, XLogP of 0.60, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-diethyl-3-[methyl(2-pyrrolidin-1-ylethyl)amino]butanamide is sourced from PubChem (CID 66431891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).