4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide

C14H29N3O — CID 66432868

IUPAC4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
SMILESCCN(CC1CC1)C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C14H29N3O/c1-5-17(10-11-6-7-11)12(9-15)8-13(18)16-14(2,3)4/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyLEJLQMKZGKVYDS-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds7

About 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide

4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide (PubChem CID 66432868) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
PubChem CID66432868
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
SMILESCCN(CC1CC1)C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C14H29N3O/c1-5-17(10-11-6-7-11)12(9-15)8-13(18)16-14(2,3)4/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyLEJLQMKZGKVYDS-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-[cyclopropylmethyl(ethyl)amino]-N-methylbutanamide
CID 66427576
4-amino-N-cyclopropyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
CID 66432647
4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide
CID 107397676
4-amino-3-[cyclopropylmethyl(ethyl)amino]-1-pyrrolidin-1-ylbutan-1-one
CID 66430078
4-amino-N-tert-butyl-3-[cycloheptyl(methyl)amino]butanamide
CID 66430006
4-amino-N-tert-butyl-3-[methyl(propyl)amino]butanamide
CID 66431224
4-amino-N-tert-butyl-3-[1-(dimethylamino)propan-2-yl-ethylamino]butanamide
CID 103188107
4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide
CID 66430004
2-N-(cyclobutylmethyl)-2-N-ethyl-4,4-dimethylpentane-1,2-diamine
CID 107397832
tert-butyl N-[4-amino-3-[cyclobutylmethyl(ethyl)amino]butyl]carbamate
CID 107397726
4-amino-N-tert-butyl-3-[methyl(oxan-2-ylmethyl)amino]butanamide
CID 66432458
4-amino-3-[ethyl(oxolan-2-ylmethyl)amino]-N-methylbutanamide
CID 66427136

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide?
The IUPAC name of 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide (CID 66432868) is 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide.
What is the SMILES notation for 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide?
The canonical SMILES for 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide is CCN(CC1CC1)C(CN)CC(=O)NC(C)(C)C.
What is the InChIKey of 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide?
The InChIKey is LEJLQMKZGKVYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-17(10-11-6-7-11)12(9-15)8-13(18)16-14(2,3)4/h11-12H,5-10,15H2,1-4H3,(H,16,18).
What are the key properties of 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide?
4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide is sourced from PubChem (CID 66432868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).