4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide

C14H28N4O — CID 83010707

IUPAC4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide
SMILESCC1CCCC(C)N1NC(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H28N4O/c1-10-4-3-5-11(2)18(10)17-13(9-15)8-14(19)16-12-6-7-12/h10-13,17H,3-9,15H2,1-2H3,(H,16,19)
InChIKeyBHJURBSXFSCQKR-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.75
Rot. Bonds6

About 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide

4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide (PubChem CID 83010707) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide
PubChem CID83010707
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide
SMILESCC1CCCC(C)N1NC(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H28N4O/c1-10-4-3-5-11(2)18(10)17-13(9-15)8-14(19)16-12-6-7-12/h10-13,17H,3-9,15H2,1-2H3,(H,16,19)
InChIKeyBHJURBSXFSCQKR-UHFFFAOYSA-N
XLogP0.75
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(2,6-dimethylpiperidin-1-yl)butane-1,2-diamine
CID 83011142
4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
4-amino-N-cyclopropyl-3-(3,4,5-trimethylpiperazin-1-yl)butanamide
CID 114537377
4-amino-N-cyclopropyl-3-(1-hydroxypentan-3-ylamino)butanamide
CID 113495658
N-cyclohexyl-2-[(2,6-dimethylpiperidin-1-yl)amino]acetamide
CID 83014611
3-(aminomethyl)-N-(2,6-dimethylpiperidin-1-yl)pentanamide
CID 83021752
(3S)-3-amino-N-cyclobutylbutanamide
CID 94423965
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide
CID 66431608
2-N-(2,6-dimethylpiperidin-1-yl)-3-methylbutane-1,2-diamine
CID 83011635
4-amino-N-cyclopropyl-3-(1-phenylethylamino)butanamide
CID 66430398
(3S)-3-(aminomethyl)-N-(2,6-dimethylpiperidin-1-yl)-5-methylhexanamide
CID 83020793

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide?
The IUPAC name of 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide (CID 83010707) is 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide?
The canonical SMILES for 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide is CC1CCCC(C)N1NC(CN)CC(=O)NC1CC1.
What is the InChIKey of 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide?
The InChIKey is BHJURBSXFSCQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-10-4-3-5-11(2)18(10)17-13(9-15)8-14(19)16-12-6-7-12/h10-13,17H,3-9,15H2,1-2H3,(H,16,19).
What are the key properties of 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide?
4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide has a molecular weight of 268.40 g/mol, XLogP of 0.75, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-3-[(2,6-dimethylpiperidin-1-yl)amino]butanamide is sourced from PubChem (CID 83010707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).