N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine

C10H15N3O2 — CID 131153457

IUPACN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine
SMILESCC1(CCNc2ncccn2)OCCO1
InChIInChI=1S/C10H15N3O2/c1-10(14-7-8-15-10)3-6-13-9-11-4-2-5-12-9/h2,4-5H,3,6-8H2,1H3,(H,11,12,13)
InChIKeyDKXFNIIBSACZAX-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.04
Rot. Bonds4

About N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine

N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine (PubChem CID 131153457) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine
PubChem CID131153457
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine
SMILESCC1(CCNc2ncccn2)OCCO1
InChIInChI=1S/C10H15N3O2/c1-10(14-7-8-15-10)3-6-13-9-11-4-2-5-12-9/h2,4-5H,3,6-8H2,1H3,(H,11,12,13)
InChIKeyDKXFNIIBSACZAX-UHFFFAOYSA-N
XLogP1.04
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-4-phenylmethoxypyrimidin-2-amine
CID 133459100
6-ethyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133459201
2-(2-methyl-1,3-dioxolan-2-yl)-N-[phenyl(pyridin-2-yl)methyl]ethanamine
CID 86791432
2-methyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyridine-3-carboxamide
CID 75506217
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-phenyltetrazol-5-amine
CID 133459238
N,N'-di(pyrimidin-2-yl)dodecane-1,12-diamine
CID 169229750
6-bromo-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]quinazolin-4-amine
CID 133459268
1-(furan-2-yl)-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]ethanamine
CID 104628579
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-2-amine
CID 133459006
N-(2-iodoethyl)pyrimidin-2-amine
CID 122607356
N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
CID 103736890
N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 63822155

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine?
The IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine (CID 131153457) is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine.
What is the SMILES notation for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine?
The canonical SMILES for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine is CC1(CCNc2ncccn2)OCCO1.
What is the InChIKey of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine?
The InChIKey is DKXFNIIBSACZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(14-7-8-15-10)3-6-13-9-11-4-2-5-12-9/h2,4-5H,3,6-8H2,1H3,(H,11,12,13).
What are the key properties of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine?
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine has a molecular weight of 209.25 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]pyrimidin-2-amine is sourced from PubChem (CID 131153457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).