2-(heptylamino)-N,N-dimethylacetamide

C11H24N2O — CID 43214901

IUPAC2-(heptylamino)-N,N-dimethylacetamide
SMILESCCCCCCCNCC(=O)N(C)C
InChIInChI=1S/C11H24N2O/c1-4-5-6-7-8-9-12-10-11(14)13(2)3/h12H,4-10H2,1-3H3
InChIKeySFCLNVWBXPLXCW-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.63
Rot. Bonds8

About 2-(heptylamino)-N,N-dimethylacetamide

2-(heptylamino)-N,N-dimethylacetamide (PubChem CID 43214901) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-(heptylamino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(heptylamino)-N,N-dimethylacetamide
PubChem CID43214901
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-(heptylamino)-N,N-dimethylacetamide
SMILESCCCCCCCNCC(=O)N(C)C
InChIInChI=1S/C11H24N2O/c1-4-5-6-7-8-9-12-10-11(14)13(2)3/h12H,4-10H2,1-3H3
InChIKeySFCLNVWBXPLXCW-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-2-(3-propoxypropylamino)acetamide
CID 82942914
2-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-[4-(tetradecylamino)butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]butylamino]acetic acid
CID 175074033
sodium;2-(hexadecylamino)acetic acid;hydride
CID 174739572
copper(1+);2-(octylamino)acetate
CID 21278666
2-[2-[2-(hexadecylamino)ethylamino]ethylamino]acetic acid
CID 10091506
carbonic acid;N-hexylhexan-1-amine
CID 174995198
3-[2-(dodecylamino)ethyl]-1,1-dimethylurea
CID 83113481
N,N-dimethyl-2-(3-methylsulfonylpropylamino)acetamide
CID 61037616
2-[2-[ethyl(methyl)amino]ethylamino]-N,N-dimethylacetamide
CID 62640483
methyl 2-(hexylamino)acetate;hydrochloride
CID 141426324
N-ethyl-2-(5-hydroxypentylamino)-N-methylacetamide
CID 107317457
ethane;2-(ethylamino)-N,N-dimethylacetamide
CID 162757499

Frequently Asked Questions

What is the IUPAC name of 2-(heptylamino)-N,N-dimethylacetamide?
The IUPAC name of 2-(heptylamino)-N,N-dimethylacetamide (CID 43214901) is 2-(heptylamino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(heptylamino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(heptylamino)-N,N-dimethylacetamide is CCCCCCCNCC(=O)N(C)C.
What is the InChIKey of 2-(heptylamino)-N,N-dimethylacetamide?
The InChIKey is SFCLNVWBXPLXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-5-6-7-8-9-12-10-11(14)13(2)3/h12H,4-10H2,1-3H3.
What are the key properties of 2-(heptylamino)-N,N-dimethylacetamide?
2-(heptylamino)-N,N-dimethylacetamide has a molecular weight of 200.33 g/mol, XLogP of 1.63, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(heptylamino)-N,N-dimethylacetamide is sourced from PubChem (CID 43214901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).