2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide

C14H28N4O — CID 63055622

IUPAC2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)N1CCN(CCC(NC2CC2)C(N)=O)CC1
InChIInChI=1S/C14H28N4O/c1-11(2)18-9-7-17(8-10-18)6-5-13(14(15)19)16-12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H2,15,19)
InChIKeyCYEHINVECHECCW-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.01
Rot. Bonds7

About 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide

2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide (PubChem CID 63055622) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide
PubChem CID63055622
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)N1CCN(CCC(NC2CC2)C(N)=O)CC1
InChIInChI=1S/C14H28N4O/c1-11(2)18-9-7-17(8-10-18)6-5-13(14(15)19)16-12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H2,15,19)
InChIKeyCYEHINVECHECCW-UHFFFAOYSA-N
XLogP0.01
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-4-(4-cyclopropylpiperazin-1-yl)butanamide
CID 55144900
2-(propan-2-ylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 55145462
4-(4-tert-butylpiperidin-1-yl)-2-(cyclopropylamino)butanamide
CID 63054348
2-(cyclopropylamino)-4-[(2S,6R)-2,6-dimethylpiperidin-1-yl]butanamide
CID 104968607
2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide
CID 63053798
2-(cyclopropylamino)-5-(methylamino)hexanediamide
CID 66221949
2-(cyclopropylamino)-4-(3-methoxy-3-methylpiperidin-1-yl)butanamide
CID 107394779
2-(cyclopropylamino)-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butanamide
CID 63053319
4-(azepan-1-yl)-2-(cyclopropylamino)butanoic acid
CID 55145645
4-(4-methylpiperidin-1-yl)-2-(propan-2-ylamino)butanamide
CID 63028170
methyl 4-methyl-2-[(1-propan-2-ylpiperidin-4-yl)amino]pentanoate
CID 43688946
2-(cyclopropylamino)-4-(4,4-dimethylpiperidin-1-yl)butanoic acid
CID 63055407

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide?
The IUPAC name of 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide (CID 63055622) is 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide is CC(C)N1CCN(CCC(NC2CC2)C(N)=O)CC1.
What is the InChIKey of 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide?
The InChIKey is CYEHINVECHECCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-11(2)18-9-7-17(8-10-18)6-5-13(14(15)19)16-12-3-4-12/h11-13,16H,3-10H2,1-2H3,(H2,15,19).
What are the key properties of 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide?
2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide has a molecular weight of 268.40 g/mol, XLogP of 0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide is sourced from PubChem (CID 63055622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).